Excess proton solvation and delocalization in a hydrophilic pocket of the proton conducting polymer membrane Nafion

Journal of Physical Chemistry B

Volumn 109, Issue 9, 2005, Pages 3727-3730

  Petersen, Matt K ^a   Wang, Feng ^a   Blake, Nick P ^b   Metiu, Horia ^b   Voth, Gregory A ^a  

^a UNIVERSITY OF UTAH   (United States)

^b UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

GROTTHUSS DELOCALIZATION; METHANOL FUEL CELLS; NAFLON; PROTON SOLVATION;

CHEMICAL BONDS; COMPUTER SIMULATION; CONDUCTIVE PLASTICS; ELECTROLYTES; HYDRATION; HYDROPHILICITY; MOLECULAR DYNAMICS; POSITIVE IONS; SOLVENTS;

POLYMERIC MEMBRANES;

FLUOROCARBON; PERFLUOROSULFONIC ACID; POLYMER; PROTON;

CHEMICAL STRUCTURE; CHEMISTRY; LETTER; SOLUBILITY;

FLUOROCARBON POLYMERS; MODELS, MOLECULAR; POLYMERS; PROTONS; SOLUBILITY;

EID: 15544364795     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp044535g     Document Type: Article

References (23)

1. Paddison, S. J. J. New Mater. Electrochem. System 2001, 4, 197.
2. Vishnyakov, A.; Neimark, A. V. J. Phys. Chem. B 2001, 105, 9586.
3. Jang, S. S.; Molinero, V.; Cagin, T.; Goddard, W. A., III. J. Phys. Chem. B 2004, 108, 3149.
4. Elliott, J. A.; Hanna, S.; Elliot, A. M. S.; Cooley, G. E. Phys. Chem. Chem. Phys. 1999, 1, 4855.
5. Paddison, S. J.; Paul, R.; Zawodzinski T. A J. Chem. Phys. 2001, 115, 7753.
6. Zawodzinski, T. A.; Neeman, M.; Sillerud, L. O.; Gottesfeld, S. J. Phys. Chem. 1991, 95, 6040.
7. Laporta, M.; Pegoraro, M.; Zanderighi, L. Phys. Chem. Chem. Phys. 1999, 1, 4619.
8. Rollet, A. L.; Dial, O.; Gebel, G. J. Phys. Chem. B 2002, 106, 3033.
9. Loppinet, B.; Gebel, G.; Williams, C. E.; J. Phys. Chem. B 1997, 101, 1884.
10. Agmon, N. Chem. Phys. Lett. 1995, 244, 456.
11. Bell, R. P. The Proton in chemistry; Cornell University Press: Ithaca, New York, 1973.
12. Lobaugh, J.; Voth, G. A. J. Chem. Phys. 1996, 104, 2056.
13. Schmitt, U. W.; Voth, G. A. J. Chem. Phys. 1999, 111, 9361.
14. Cuma, M.; Schmitt, U. W.; Voth, G. A.; J. Phys. Chem. A 2001, 105, 2814.
15. Day, T. J. F.; Soudackov, A. V.; Cuma, M.; Schmitt, U. W.; Voth, G. A. J. Chem. Phys. 2002, 117, 5839.
16. Spohr, E.; Commer, P.; Kornyshev, A. A. J. Phys. Chem. B 2002, 106, 10560.
17. Morris, D. R.; Xiaodong, S. J. Appl. Polym. Sci. 1993, 50, 1445.
18. Agmon, N. J. Phys. Chem. A 1998, 102, 192.
19. Kameda, Y.; Usuki, T.; Uemura, O. Bull. Chem. Soc. Jpn. 1998, 71, 1305.
20. Wang, F.; Voth, G. A., in press.
21. Omta, A. W.; Kropman, M. F.; Woutersen, S.; Bakker, H. J. Science 2003, 301, 347.
22. Illustrations created with the visualization package VMD.; Humphrey, W.; Dalke, A.; Schulten, K. J. Mol. Graphics 1996, 14, 33.
23. Illustrations rendered with Raster3D.; Merritt, E. A.; Murphy, M. E. P. Acta Crystallogr. 1994, D50, 869.